N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide

C21H19N5O — CID 71602077

IUPACN-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCNC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1
InChIInChI=1S/C21H19N5O/c1-2-23-21(27)17-12-19(16-6-4-3-5-7-16)25-20-18(17)13-24-26(20)14-15-8-10-22-11-9-15/h3-13H,2,14H2,1H3,(H,23,27)
InChIKeyCGIOPECUDSKKRL-UHFFFAOYSA-N
MW357.42 g/mol
LogP3.29
Rot. Bonds5

About N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide

N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 71602077) has the molecular formula C21H19N5O and a molecular weight of 357.42 g/mol. Its IUPAC name is N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID71602077
Molecular FormulaC21H19N5O
Molecular Weight357.42 g/mol
Exact Mass357.16
IUPAC NameN-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCNC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1
InChIInChI=1S/C21H19N5O/c1-2-23-21(27)17-12-19(16-6-4-3-5-7-16)25-20-18(17)13-24-26(20)14-15-8-10-22-11-9-15/h3-13H,2,14H2,1H3,(H,23,27)
InChIKeyCGIOPECUDSKKRL-UHFFFAOYSA-N
XLogP3.29
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 71602077) is N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide is CCNC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1.
What is the InChIKey of N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is CGIOPECUDSKKRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O/c1-2-23-21(27)17-12-19(16-6-4-3-5-7-16)25-20-18(17)13-24-26(20)14-15-8-10-22-11-9-15/h3-13H,2,14H2,1H3,(H,23,27).
What are the key properties of N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 357.42 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 71602077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).